| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2008 | 21 | Yes |
Popular Name: (2S)-N-[(1R)-1-(2,4-dimethylphenyl)ethyl]-3-methyl-2-pyrrolidin-1-yl-butan-1-amine (2S)-N-[(1R)-1-(2,4-dimethylphen…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 4.42 | 9.63 | -35.89 | 2 | 2 | 1 | 20 | 289.487 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.42 | 11.11 | -32.04 | 2 | 2 | 1 | 16 | 289.487 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.42 | 11.66 | -112.12 | 3 | 2 | 2 | 21 | 290.495 | 6 | ↓ |
